Geometry & MOs

Info

ID:	27753
PubChem CID:	823433
Reduced:	ClFNO2H9C15 (1)
Stoich.:	ABCD2E9F15 (1)
Weight, g/mol:	337.095023
ΔH_f, kcal/mol:	-59.0
Dipole, Da:	3.96
IP(EA), eV:	-9.15(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-(4-methoxyphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations